Basic information
- CAS
84731-74-8- Standard SMILES
CC(=O)OC1(c2ccccn2)CCCCC1- InChIKey
OBWWYNFWJUGTMA-UHFFFAOYSA-N- Molecular formula
- C13H17NO2
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.12592879
Names & identifiers
- Preferred name
- 1-(Pyridin-2-yl)cyclohexyl acetate
- IUPAC
- (1-pyridin-2-ylcyclohexyl) acetate
- English name
- 1-(pyridin-2-yl)cyclohexyl acetate
- Molecular formula
- C13H17NO2
- Molecular weight
- 219.27958
Names & synonyms
1-(Pyridin-2-yl)cyclohexyl acetate84731-74-8EINECS 283-833-4DTXSID80233753OBWWYNFWJUGTMA-UHFFFAOYSA-NNS000386401-(2-Pyridinyl)cyclohexanol acetateCyclohexanol,1-(2-pyridinyl)-, 1-acetate
Database identifiers
- CAS
84731-74-8- PubChem CID
- 3020109
- DTXSID
DTXSID80233753- EC Number
- 283-833-4
- Nikkaji
- J309.123F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Chemistry & industry
Suppliers1 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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